acridine; 2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: acridine; 2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: acridine; 2-(6-aminopurin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: acridine; 2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: acridine; 2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: acridine; 2-adenin-9-yl-5-methylol-tetrahydrofuran-3,4-diol Formula: C23H22N6O4 MolecularWeight: 446.45858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=N2.C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=N2.C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)O

InChI

InChI=1S/C13H9N.C10H13N5O4/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12;11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h1-9H;2-4,6-7,10,16-18H,1H2,(H2,11,12,13)